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ScientificNameLabel
sesquithuriferol
PHCD compound ID : 476
Chemical Names :
sesquithuriferol
Molecular Formula : C15H26O1
Molecular Weight : 222.198365
More Details :
Names & Synonyms:
Smiles: O[C@@H]1[C@@]2(C)CC[C@]3(C2)[C@H](C1(C)C)CC[C@H]3C
InChi : InChI=1S/C15H26O/c1-10-5-6-11-13(2,3)12(16)14(4)7-8-15(10,11)9-14/h10-12,16H,5-9H2,1-4H3/t10-,11+,12+,14+,15-/m1/s1
InChi Key : InChIKey=UQKRCCOELQIGCU-FUQNVFFISA-N
PubChem ID : 101985389
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.891905
Hydrogen bond donor count : 1 Electric dipole moment : 1.798
XLogP : 4.732 VDW volume : 239.717079
Molecular weight : 222.198365 HOMO-LUMO gap : 13.013000
Herb list :
Refrences & Litretures:
  
29.      Journal:'Journal of Essential Oil Research'      Year:'2008'      Volume:'20'      Page:'250'      DOI:''      Title:'Aromas from Quebec. I. Composition of the essential oil of the rhizomes of Acorus calamus L'
563.      Journal:'??????'      Year:'2009'      Volume:'31'      Page:'77'      DOI:''      Title:'Essential Oil Compositions and Bioactivities of the Various Pa r t s of Cinnamomum camphora Sieb. var. linaloolifera Fujuta'
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